4-Acetyl-4'-methylbiphenyl

Base Information

• Chemical Name: 4-Acetyl-4'-methylbiphenyl
• CAS No.: 5748-38-9
• Molecular Formula: C15H14O
• Molecular Weight: 210.276
• Hs Code.: 2914399090
• DSSTox Substance ID: DTXSID00401710
• Nikkaji Number: J534.006C
• Wikidata: Q82204934
• Mol file: 5748-38-9.mol

Synonyms:4-Acetyl-4'-methylbiphenyl;5748-38-9;1-[4-(4-methylphenyl)phenyl]ethanone;1-(4'-Methyl-[1,1'-biphenyl]-4-yl)ethanone;4-Acetyl-4'-methyldiphenyl;1-(4'-Methyl-biphenyl-4-yl)-ethanone;1-(4'-methyl[1,1'-biphenyl]-4-yl)ethanone;Ethanone, 1-(4'-methyl[1,1'-biphenyl]-4-yl)-;1-(4'-methylbiphenyl-4-yl)ethanone;SCHEMBL1271569;DTXSID00401710;4-Acetyl-4'-methylbiphenyl, 98%;MFCD00191374;AKOS004113748;AS-6259;BB 0222553;FT-0635834;T71080;A831459;1-(4'-Methyl[1,1'-biphenyl]-4-yl)ethanone, AldrichCPR

Chemical Property of 4-Acetyl-4'-methylbiphenyl

Chemical Property:

• Vapor Pressure: 9.51E-05mmHg at 25°C
• Melting Point: 122 °C(Solv: ethanol (64-17-5))
• Refractive Index: 1.562
• Boiling Point: 338.9 °C at 760 mmHg
• Flash Point: 145.5 °C
• PSA: 17.07000
• Density: 1.038 g/cm³
• LogP: 3.86460
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 210.104465066
• Heavy Atom Count: 16
• Complexity: 230

Purity/Quality:

98% ^*data from raw suppliers

4-Acetyl-4''-Methylbiphenyl ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C

Technology Process of 4-Acetyl-4'-methylbiphenyl

There total 7 articles about 4-Acetyl-4'-methylbiphenyl which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 88.0%

para-bromoacetophenone (99-90-1) + tri(p-tolyl)bismuth (5142-75-6) → (4,4'-dimethyl-1,1'-biphenyl) (613-33-2) + 4-acetyl-4'-methylbiphenyl (5748-38-9)

Guidance literature:

With caesium carbonate; triphenylphosphine; palladium dichloride; In N,N-dimethyl acetamide; at 90 ℃; for 2h;

DOI:10.1016/j.tet.2008.04.011

Reference yield: 82.0%

4-acetophenyl triflate (109613-00-5) + tri(p-tolyl)bismuth (5142-75-6) → (4,4'-dimethyl-1,1'-biphenyl) (613-33-2) + 4-acetyl-4'-methylbiphenyl (5748-38-9)

Guidance literature:

With tetrabutylammomium bromide; caesium carbonate; triphenylphosphine; palladium dichloride; In N,N-dimethyl acetamide; at 90 ℃; for 1h;

DOI:10.1016/j.tet.2008.04.011

Reference yield: 81.0%

4-Iodoacetophenone (13329-40-3) + tri(p-tolyl)bismuth (5142-75-6) → (4,4'-dimethyl-1,1'-biphenyl) (613-33-2) + 4-acetyl-4'-methylbiphenyl (5748-38-9)

Guidance literature:

With caesium carbonate; triphenylphosphine; palladium dichloride; In N,N-dimethyl acetamide; at 90 ℃; for 1h;

DOI:10.1016/j.tet.2008.04.011

upstream raw materials:

para-bromoacetophenone

4-Iodoacetophenone

tri(p-tolyl)bismuth

4-acetophenyl triflate

Downstream raw materials:

1,3,5-tris<4-(4'-(bromomethyl)phenylyl)phenyl>benzene

1,3,5-tris<4-<4'-((N-benzylamino)methyl)phenylyl>phenyl>benzene

C₆₆H₆₆N₂O₁₄S₂

C₂₃H₁₈F₃N₃

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